SCHEMBL21945079

SCHEMBL21945079

C/N=C\c1[nH]nnc1-c1ccc(OC)c(OCc2cc(C(F)(F)F)ccc2C(F)(F)F)c1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ESRRA P11474 10/20 0.36
▸ FFAR1 O14842 1/20 0.34
▸ FFAR2 O15552 1/20 0.34
▸ FFAR4 Q5NUL3 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ USP2 O75604 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ MRGPRX4 Q96LA9 1/20 0.33
▸ SRD5A2 P31213 1/20 0.33
▸ MGAM O43451 3/20 0.32
▸ GAA P10253 3/20 0.32
▸ SI P14410 3/20 0.32
▸ MGAM2 Q2M2H8 3/20 0.32
▸ CHEK1 O14757 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL21945753 0.86 SRD5A2 (0.44) SRD5A2
SCHEMBL21945695 0.84 NR1H2 (0.40) NPC1RAB9ASRD5A2
SCHEMBL18004182 0.83 ESRRA (0.41) ESRRAFFAR1FFAR2FFAR4MEN1
SCHEMBL26070335 0.79 QPCT (0.32) —
SCHEMBL26070378 0.78 MRGPRX4 (0.43) MRGPRX4GAA
SCHEMBL21945735 0.77 PRMT6 (0.34) MEN1KMT2AMRGPRX4
SCHEMBL26070309 0.76 SRD5A2 (0.34) FFAR1FFAR4MRGPRX4SRD5A2
SCHEMBL21944776 0.74 MRGPRX4 (0.48) MRGPRX4
SCHEMBL21944756 0.73 ABCC8 (0.32) —
SCHEMBL21944841 0.71 C5AR1 (0.32) —

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10626095-B2 Cyanotriazole compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2020-04-21 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10626095-B2 Cyanotriazole compounds CS, PC, ACAT1 ESRRA 1413/4885FFAR1 1292/4885FFAR2 1387/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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